Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 10/20 | 0.44 |
| ▸ | TACR1 | P25103 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.38 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.37 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.36 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.36 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL381030 | 0.92 | EPHX2 (0.43) | EPHX2POLBCYP2C9CYP2C19AKR1C2 | |
| SCHEMBL381326 | 0.90 | EPHX2 (0.40) | EPHX2CYP2C19MTNR1BMTNR1A | |
| SCHEMBL13031210 | 0.90 | EPHX2 (0.40) | EPHX2CYP2C19MTNR1BMTNR1A | |
| SCHEMBL380635 | 0.86 | GPR119 (0.51) | EPHX2AKR1C2AKR1C1 | |
| SCHEMBL380636 | 0.86 | GPR119 (0.51) | EPHX2AKR1C2AKR1C1 | |
| SCHEMBL13072165 | 0.85 | HRH2 (0.45) | EPHX2POLBAKR1C2AKR1C1CHRM2 | |
| SCHEMBL380490 | 0.83 | AKR1C2 (0.37) | EPHX2AKR1C2AKR1C1CHRM2CHRM5 | |
| SCHEMBL3563830 | 0.83 | AKR1C2 (0.38) | AKR1C2AKR1C1CHRM2CHRM5CHRM1 | |
| SCHEMBL3563833 | 0.83 | AKR1C2 (0.38) | AKR1C2AKR1C1CHRM2CHRM5CHRM1 | |
| Trifluoroacetic Acid SCHEMBL381863 | 0.82 | AKR1C2 (0.41) | AKR1C2AKR1C1CHRM2CHRM5CHRM1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2049513-B1 | PIPERIDINYL SUBSTITUTED PYRROLIDINONES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 | LILLY CO ELI (US) | 2012-01-25 | — | — | EP | claimed |